N-[[7-chloranyl-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]thiophene-3-sulfonamide

Systemtic Name: N-[[7-chloranyl-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]thiophene-3-sulfonamide Openeye Name: N-[[7-chloro-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]thiophene-3-sulfonamide CAS Name: N-[[7-chloro-4-[(4-fluorophenyl)methylamino]-2-quinazolinyl]methyl]-3-thiophenesulfonamide IUPAC Name: N-[[7-chloro-4-[(4-fluorophenyl)methylamino]quinazolin-2-yl]methyl]thiophene-3-sulfonamide Traditional Name: N-[[7-chloro-4-[(4-fluorobenzyl)amino]quinazolin-2-yl]methyl]thiophene-3-sulfonamide Formula: C20H16ClFN4O2S2 MolecularWeight: 462.948043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NC(=NC3=C2C=CC(=C3)Cl)CNS(=O)(=O)C4=CSC=C4)F

Isomeric SMILES

C1=CC(=CC=C1CNC2=NC(=NC3=C2C=CC(=C3)Cl)CNS(=O)(=O)C4=CSC=C4)F

InChI

InChI=1S/C20H16ClFN4O2S2/c21-14-3-6-17-18(9-14)25-19(11-24-30(27,28)16-7-8-29-12-16)26-20(17)23-10-13-1-4-15(22)5-2-13/h1-9,12,24H,10-11H2,(H,23,25,26)